CID 376286

Nsc657000

Structural Information

Molecular Formula
C19H21N3O2
SMILES
CC1C(N(C(C(C1=NO)C)C2=CC=CC=C2)N=O)C3=CC=CC=C3
InChI
InChI=1S/C19H21N3O2/c1-13-17(20-23)14(2)19(16-11-7-4-8-12-16)22(21-24)18(13)15-9-5-3-6-10-15/h3-14,18-19,23H,1-2H3
InChIKey
OKZJJNGCIWTGDK-UHFFFAOYSA-N
Compound name
N-(3,5-dimethyl-1-nitroso-2,6-diphenylpiperidin-4-ylidene)hydroxylamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

323.1634 Da
Monoisotopic Mass

4.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 324.170676 177.4
[M+Na]+ 346.152618 183.9
[M-H]- 322.156124 187.0
[M+NH4]+ 341.197223 190.2
[M+K]+ 362.126558 179.4
[M+H-H2O]+ 306.160660 166.9
[M+HCOO]- 368.161601 200.0
[M+CH3COO]- 382.177251 216.9
[M+Na-2H]- 344.138066 180.1
[M]+ 323.16285142 175.6
[M]- 323.16394858 175.6
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.