CID 53229891

2248381-88-4

Structural Information

Molecular Formula
C9H11NO
SMILES
C1CC1OC2=CC=CC(=C2)N
InChI
InChI=1S/C9H11NO/c10-7-2-1-3-9(6-7)11-8-4-5-8/h1-3,6,8H,4-5,10H2
InChIKey
NFRVQIJUWWANJH-UHFFFAOYSA-N
Compound name
3-cyclopropyloxyaniline
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

32
Patents

149.08406 Da
Monoisotopic Mass

1.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 150.09134 127.0
[M+Na]+ 172.07328 136.5
[M-H]- 148.07678 134.5
[M+NH4]+ 167.11788 143.1
[M+K]+ 188.04722 133.8
[M+H-H2O]+ 132.08132 120.7
[M+HCOO]- 194.08226 152.8
[M+CH3COO]- 208.09791 180.6
[M+Na-2H]- 170.05873 134.6
[M]+ 149.08351 128.3
[M]- 149.08461 128.3
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