CID 217576

38936-62-8

Structural Information

Molecular Formula
C8H11NO
SMILES
CC1=CC=C(C=C1)CON
InChI
InChI=1S/C8H11NO/c1-7-2-4-8(5-3-7)6-10-9/h2-5H,6,9H2,1H3
InChIKey
MLWXTMVARHZBPA-UHFFFAOYSA-N
Compound name
O-[(4-methylphenyl)methyl]hydroxylamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

178
Patents

137.08406 Da
Monoisotopic Mass

1.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 138.091336 126.6
[M+Na]+ 160.073278 134.5
[M-H]- 136.076784 130.1
[M+NH4]+ 155.117883 148.1
[M+K]+ 176.047218 133.0
[M+H-H2O]+ 120.081320 121.0
[M+HCOO]- 182.082261 152.2
[M+CH3COO]- 196.097911 175.5
[M+Na-2H]- 158.058726 134.0
[M]+ 137.08351142 126.2
[M]- 137.08460858 126.2
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

patents stripe