CID 44780

N-(6-(dimethylamino)-4,4-diphenyl-3-heptylidene)acetamide hydrochloride

Structural Information

Molecular Formula
C23H30N2O
SMILES
CCC(=NC(=O)C)C(CC(C)N(C)C)(C1=CC=CC=C1)C2=CC=CC=C2
InChI
InChI=1S/C23H30N2O/c1-6-22(24-19(3)26)23(17-18(2)25(4)5,20-13-9-7-10-14-20)21-15-11-8-12-16-21/h7-16,18H,6,17H2,1-5H3
InChIKey
NJFKSPAGUGTCMW-UHFFFAOYSA-N
Compound name
N-[6-(dimethylamino)-4,4-diphenylheptan-3-ylidene]acetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

350.2358 Da
Monoisotopic Mass

4.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 351.243076 189.7
[M+Na]+ 373.225018 191.5
[M-H]- 349.228524 197.6
[M+NH4]+ 368.269623 202.7
[M+K]+ 389.198958 189.2
[M+H-H2O]+ 333.233060 180.4
[M+HCOO]- 395.234001 211.1
[M+CH3COO]- 409.249651 226.6
[M+Na-2H]- 371.210466 190.7
[M]+ 350.23525142 191.2
[M]- 350.23634858 191.2
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

No literature data available for this compound.

Patent stripe

No patent data available for this compound.