CID 2760372

63201-02-5

Structural Information

Molecular Formula
C10H9ClO
SMILES
C1CC1(C2=CC=CC=C2)C(=O)Cl
InChI
InChI=1S/C10H9ClO/c11-9(12)10(6-7-10)8-4-2-1-3-5-8/h1-5H,6-7H2
InChIKey
NSSCREWKCZJMTL-UHFFFAOYSA-N
Compound name
1-phenylcyclopropane-1-carbonyl chloride
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

168
Patents

180.0342 Da
Monoisotopic Mass

2.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 181.04148 137.8
[M+Na]+ 203.02342 153.3
[M+NH4]+ 198.06802 149.5
[M+K]+ 218.99736 145.4
[M-H]- 179.02692 148.5
[M+Na-2H]- 201.00887 150.4
[M]+ 180.03365 144.7
[M]- 180.03475 144.7
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