CID 9569633

Ec 700-765-7

Structural Information

Molecular Formula
C12H11NO
SMILES
C/C(=N\O)/C1=CC=CC2=CC=CC=C21
InChI
InChI=1S/C12H11NO/c1-9(13-14)11-8-4-6-10-5-2-3-7-12(10)11/h2-8,14H,1H3/b13-9+
InChIKey
KHNGQTJKEPANSZ-UKTHLTGXSA-N
Compound name
(NE)-N-(1-naphthalen-1-ylethylidene)hydroxylamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

9
Patents

185.08406 Da
Monoisotopic Mass

3.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 186.09134 137.7
[M+Na]+ 208.07328 145.4
[M-H]- 184.07678 142.4
[M+NH4]+ 203.11788 158.4
[M+K]+ 224.04722 142.4
[M+H-H2O]+ 168.08132 131.5
[M+HCOO]- 230.08226 161.7
[M+CH3COO]- 244.09791 185.1
[M+Na-2H]- 206.05873 146.1
[M]+ 185.08351 137.2
[M]- 185.08461 137.2
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe