CID 83237

13213-36-0

Structural Information

Molecular Formula
C9H11NO
SMILES
CC(=NO)CC1=CC=CC=C1
InChI
InChI=1S/C9H11NO/c1-8(10-11)7-9-5-3-2-4-6-9/h2-6,11H,7H2,1H3
InChIKey
AUYFJUMCPAMOKN-UHFFFAOYSA-N
Compound name
N-(1-phenylpropan-2-ylidene)hydroxylamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

3
References

87
Patents

149.08406 Da
Monoisotopic Mass

1.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 150.091336 130.6
[M+Na]+ 172.073278 137.3
[M-H]- 148.076784 134.3
[M+NH4]+ 167.117883 151.5
[M+K]+ 188.047218 135.7
[M+H-H2O]+ 132.081320 124.7
[M+HCOO]- 194.082261 155.7
[M+CH3COO]- 208.097911 177.4
[M+Na-2H]- 170.058726 137.9
[M]+ 149.08351142 129.8
[M]- 149.08460858 129.8
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