CID 5744118

93777-31-2

Structural Information

Molecular Formula
C15H22
SMILES
CC1C=CC=C2C1(CC(CC2)C(=C)C)C
InChI
InChI=1S/C15H22/c1-11(2)13-8-9-14-7-5-6-12(3)15(14,4)10-13/h5-7,12-13H,1,8-10H2,2-4H3
InChIKey
NJUGTTLPVRLVGH-UHFFFAOYSA-N
Compound name
4a,5-dimethyl-3-prop-1-en-2-yl-2,3,4,5-tetrahydro-1H-naphthalene
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

202.17215 Da
Monoisotopic Mass

5.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 203.179426 147.7
[M+Na]+ 225.161368 153.8
[M-H]- 201.164874 151.6
[M+NH4]+ 220.205973 170.2
[M+K]+ 241.135308 150.4
[M+H-H2O]+ 185.169410 142.3
[M+HCOO]- 247.170351 165.0
[M+CH3COO]- 261.186001 189.7
[M+Na-2H]- 223.146816 151.4
[M]+ 202.17160142 143.8
[M]- 202.17269858 143.8
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.