CID 26620

Einecs 224-780-9

Structural Information

Molecular Formula
C10H15ClO
SMILES
CC(=CC1C(C1(C)C)C(=O)Cl)C
InChI
InChI=1S/C10H15ClO/c1-6(2)5-7-8(9(11)12)10(7,3)4/h5,7-8H,1-4H3
InChIKey
VNTCVNLNEOVBEE-UHFFFAOYSA-N
Compound name
2,2-dimethyl-3-(2-methylprop-1-enyl)cyclopropane-1-carbonyl chloride
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

1
References

262
Patents

186.08115 Da
Monoisotopic Mass

4.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 187.08843 135.5
[M+Na]+ 209.07037 146.1
[M-H]- 185.07387 140.6
[M+NH4]+ 204.11497 153.8
[M+K]+ 225.04431 142.6
[M+H-H2O]+ 169.07841 132.5
[M+HCOO]- 231.07935 152.4
[M+CH3COO]- 245.09500 187.7
[M+Na-2H]- 207.05582 138.5
[M]+ 186.08060 141.0
[M]- 186.08170 141.0
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

No patent data available for this compound.