CID 99702

30121-10-9

Structural Information

Molecular Formula
C23H33NO
SMILES
CC(C)C(CCN(C(C)C)C(C)C)(C=O)C1=CC=CC2=CC=CC=C21
InChI
InChI=1S/C23H33NO/c1-17(2)23(16-25,14-15-24(18(3)4)19(5)6)22-13-9-11-20-10-7-8-12-21(20)22/h7-13,16-19H,14-15H2,1-6H3
InChIKey
YSADAPOJPAONGZ-UHFFFAOYSA-N
Compound name
2-[2-[di(propan-2-yl)amino]ethyl]-3-methyl-2-naphthalen-1-ylbutanal
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

339.25623 Da
Monoisotopic Mass

5.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 340.26351 188.0
[M+Na]+ 362.24545 190.8
[M-H]- 338.24895 192.4
[M+NH4]+ 357.29005 202.8
[M+K]+ 378.21939 188.1
[M+H-H2O]+ 322.25349 180.4
[M+HCOO]- 384.25443 205.0
[M+CH3COO]- 398.27008 224.3
[M+Na-2H]- 360.23090 188.0
[M]+ 339.25568 190.9
[M]- 339.25678 190.9
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.